1-tert-Butyl-3,5-dimethylbenzene
- Product Name1-tert-Butyl-3,5-dimethylbenzene
- CAS98-19-1
- MFC12H18
- MW162.27
- EINECS202-647-6
- MOL File98-19-1.mol
Chemical Properties
| Melting point | −22 °C (−8 °F; 251 K) |
| Boiling point | 207–209 °C (405–408 °F; 480–482 K) |
| Density | 0.86 g/mL |
| vapor pressure | 0.4 hPa (20 °C) |
| refractive index | 1.49 |
| Flash point | 72 °C |
| storage temp. | Store below +30°C. |
| form | liquid |
| color | Colorless |
| PH | 7 (H2O, 20℃) |
| BRN | 1853314 |
| Henry's Law Constant | 5.8×10-4 mol/(m3Pa) at 25℃, Zhang et al. (2010) |
| InChI | InChI=1S/C12H18/c1-9-6-10(2)8-11(7-9)12(3,4)5/h6-8H,1-5H3 |
| InChIKey | FZSPYHREEHYLCB-UHFFFAOYSA-N |
| SMILES | C1(C(C)(C)C)=CC(C)=CC(C)=C1 |
| CAS DataBase Reference | 98-19-1(CAS DataBase Reference) |
| EPA Substance Registry System | 5-tert-Butyl-m-xylene (98-19-1) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| RTECS | ZE3900000 |
| Autoignition Temperature | 560 °C DIN 51794 |
| TSCA | TSCA listed |
| HS Code | 2902 90 00 |
| Storage Class | 10 - Combustible liquids |
